COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382070
Chemical Name: N-[(1Z)-3-[(4-acetylphenyl)amino]-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-4-tert-butylbenzamide
Smiles: O=C(/C(=C/c1ccc2c(c1)OCO2)/NC(=O)c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)C(=O)C

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Molecular Weight: 484.55
Empirical Formula: C29H28N2O5

Physical State: Dry powder
Available Amount: 201 mg

Lipinsky:
logP: 5.685
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 93
Number of rings: 4

     

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